3-(1H-indol-3-yl)-2-[(4-methyl-2-oxidanylidene-chromen-3-yl)carbonylamino]propanoic acid

Systemtic Name: 3-(1H-indol-3-yl)-2-[(4-methyl-2-oxidanylidene-chromen-3-yl)carbonylamino]propanoic acid Openeye Name: 3-(1H-indol-3-yl)-2-[(4-methyl-2-oxo-chromene-3-carbonyl)amino]propanoic acid CAS Name: 3-(1H-indol-3-yl)-2-[[(4-methyl-2-oxo-1-benzopyran-3-yl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-(1H-indol-3-yl)-2-[(4-methyl-2-oxochromene-3-carbonyl)amino]propanoic acid Traditional Name: 3-(1H-indol-3-yl)-2-[(2-keto-4-methyl-chromene-3-carbonyl)amino]propionic acid Formula: C22H18N2O5 MolecularWeight: 390.38872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC=CC=C12)C(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)O

Isomeric SMILES

CC1=C(C(=O)OC2=CC=CC=C12)C(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)O

InChI

InChI=1S/C22H18N2O5/c1-12-14-6-3-5-9-18(14)29-22(28)19(12)20(25)24-17(21(26)27)10-13-11-23-16-8-4-2-7-15(13)16/h2-9,11,17,23H,10H2,1H3,(H,24,25)(H,26,27)